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(2S,3S)-1-isopropyl-3-methyl-ethylenimine-2-carboxylic acid benzyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(2S,3S)-1-isopropyl-3-methyl-ethylenimine-2-carboxylic acid benzyl ester
SpectraBase Compound ID 6EbwW1VSwpS
InChI InChI=1S/C14H19NO2/c1-10(2)15-11(3)13(15)14(16)17-9-12-7-5-4-6-8-12/h4-8,10-11,13H,9H2,1-3H3/t11-,13-,15?/m0/s1
InChIKey WIRVDGUTKMLSMY-HEIKZBPMSA-N
Mol Weight 233.31 g/mol
Molecular Formula C14H19NO2
Exact Mass 233.141579 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 67KoHhpNIY2
Name (2S,3S)-1-Isopropyl-3-methyl-ethylenimine-2-carboxylic acid benzyl ester
Comments Computed using HOSE algorithm
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Exact Mass 233.141578854 u
Formula C14H19NO2
InChI InChI=1S/C14H19NO2/c1-10(2)15-11(3)13(15)14(16)17-9-12-7-5-4-6-8-12/h4-8,10-11,13H,9H2,1-3H3/t11-,13-,15?/m0/s1
InChIKey WIRVDGUTKMLSMY-HEIKZBPMSA-N
Molecular Weight 233.311 g/mol
SMILES [C@]1(N([C@]1(C)[H])C(C)C)(C(OCC=1C=CC=CC1)=O)[H]